327031-30-1

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327031-30-1 Structure

Identification	Back Directory
[Name] Benzaldehyde, 4-hydroxy-3,5-dimethoxy-, 2-(8-methyl-5H-1,2,4-triazino[5,6-b]indol-3-yl)hydrazone
[CAS] 327031-30-1
[Synonyms] Benzaldehyde, 4-hydroxy-3,5-dimethoxy-, 2-(8-methyl-5H-1,2,4-triazino[5,6-b]indol-3-yl)hydrazone
[Molecular Formula] C19H18N6O3
[MOL File] 327031-30-1.mol
[Molecular Weight] 378.39

Chemical Properties	Back Directory
[Boiling point ] 668.7±65.0 °C(predicted)
[density ] 1.45±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)
[pka] 7.69±0.70(predicted)

Hazard Information	Back Directory
[Uses] LY2023-001 is a potent G2019S LRRK2 inhibitor with an IC50 of 12.9 nM. LY2023-001 formed stable hydrogen bonds with Glu1948, and Ala1950 in the G2019S LRRK2 protein[1].
[References] [1] Shuoyan Tan, et al. Identification of novel LRRK2 inhibitors by structure-based virtual screening and alchemical free energy calculation. Phys Chem Chem Phys. 2024 Jul 24;26(29):19775-19786. DOI:10.1039/d4cp01762e

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